Vitas-M small molecule compound
3-chloro-5-methoxy-4-{[(4-methylphenyl)sulfonyl]oxy}benzoic acid
Catalog ID
STL417896
SMILES COc1cc(cc(c1OS(=O)(=O)c1ccc(cc1)C)Cl)C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C15H13ClO6S MW 356.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClO6S/c1-9-3-5-11(6-4-9)23(19,20)22-14-12(16)7-10(15(17)18)8-13(14)21-2/h3-8H,1-2H3,(H,17,18)InChIKey
FVEKCYIFZWKTCS-UHFFFAOYSA-NSynonyms
1050894-27-31050894273
3chloro5methoxy4(((4methylphenyl)sulfonyl)oxy)benzoicacid
3chloro5methoxy4(4methylphenyl)sulfonyloxybenzoicacid
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC
InChI=1SC15H13ClO6Sc193511(649)23(1920)221412(16)710(15(17)18)813(14)212h38H12H3(H1718)
MFCD29036228
ZINC000013315097
ZINC13315097
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